Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 10/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | PRKACG | P22612 | 1/20 | 0.35 |
| ▸ | PRKACB | P22694 | 1/20 | 0.35 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9583170 | 0.91 | CDK1 (0.47) | HDAC1HDAC2HDAC8HSP90AB1HSP90AA1 | |
| SCHEMBL9584007 | 0.88 | HDAC1 (0.36) | HDAC1HDAC2HDAC8HSP90AB1HSP90AA1 | |
| SCHEMBL10405790 | 0.86 | ACHE (0.42) | CDK1CDK2 | |
| SCHEMBL10404901 | 0.83 | CDK5 (0.38) | HDAC1HDAC2CDK1CDK2CCNB1 | |
| SCHEMBL10812769 | 0.81 | MAPT (0.35) | HDAC6HDAC1HDAC4HDAC2HDAC8 | |
| SCHEMBL10816319 | 0.78 | HDAC1 (0.34) | HDAC6HDAC1HDAC4HDAC2HDAC8 | |
| SCHEMBL9583423 | 0.78 | HDAC1 (0.37) | HDAC6HDAC1HDAC2HDAC8HSP90AB1 | |
| SCHEMBL9583064 | 0.76 | CDK5 (0.38) | CDK2CCNE1 | |
| SCHEMBL27725381 | 0.76 | HSP90AA1 (0.39) | HDAC6HDAC1HDAC4HDAC2HDAC8 | |
| SCHEMBL19553602 | 0.76 | HSP90AB1 (0.47) | HDAC6HDAC1HDAC4HSP90AB1HSP90AA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5250535-A | Herpes virus; nontoxic; side effect reduction; humans and veterinary medicine | SYNTEX INC. (US) | 1993-10-05 | — | — | US | disclosed |
| US-4897479-A | VIRICIDES FOR HERPES SIMPLEX | MERCK & CO., INC. (US) | 1990-01-30 | — | — | US | disclosed |
| US-4803271-A | Process for preparing guanine derivatives | SYNTEX (U.S.A.) INC. (US) | 1989-02-07 | — | — | US | disclosed |
| US-4612314-A | Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl) purines as antiviral agent | SYNTEX (U.S.A.) INC. (US) | 1986-09-16 | — | — | US | disclosed |
| EP-0138683-A2 | Purine derivatives, their application in anti-viral compositions | MERCK & CO. INC. (US) | 1985-04-24 | — | — | EP | disclosed |
| EP-0085424-A2 | Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl)purines as antiviral agent | SYNTEX (U.S.A.) INC. (US) | 1983-08-10 | — | — | EP | disclosed |